[2-[3-ethyl-4-(phenylcarbonyloxy)phenyl]-1-benzothiophen-6-yl] benzoate

Systemtic Name: [2-[3-ethyl-4-(phenylcarbonyloxy)phenyl]-1-benzothiophen-6-yl] benzoate Openeye Name: [2-(4-benzoyloxy-3-ethyl-phenyl)benzothiophen-6-yl] benzoate CAS Name: benzoic acid [2-(4-benzoyloxy-3-ethylphenyl)-1-benzothiophen-6-yl] ester IUPAC Name: [2-(4-benzoyloxy-3-ethylphenyl)-1-benzothiophen-6-yl] benzoate Traditional Name: benzoic acid [2-(4-benzoyloxy-3-ethyl-phenyl)benzothiophen-6-yl] ester Formula: C30H22O4S MolecularWeight: 478.55828

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)C2=CC3=C(S2)C=C(C=C3)OC(=O)C4=CC=CC=C4)OC(=O)C5=CC=CC=C5

Isomeric SMILES

CCC1=C(C=CC(=C1)C2=CC3=C(S2)C=C(C=C3)OC(=O)C4=CC=CC=C4)OC(=O)C5=CC=CC=C5

InChI

InChI=1S/C30H22O4S/c1-2-20-17-23(14-16-26(20)34-30(32)22-11-7-4-8-12-22)27-18-24-13-15-25(19-28(24)35-27)33-29(31)21-9-5-3-6-10-21/h3-19H,2H2,1H3